SIMILAR PATTERNS OF AMINO ACIDS FOR 5ERG_B_SAMB401_1

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1b8a PROTEIN
(ASPARTYL-TRNA
SYNTHETASE)

(Thermococcus
kodakarensis) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		4 GLY A 293
GLY A 296
GLU A 298
ASP A 294
 None
 0.68A 5ergB-1b8aA:
undetectable		 5ergB-1b8aA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bhy P64K

(Neisseria
meningitidis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		4 GLY A 129
GLY A 131
GLU A 152
ASP A 232
 FAD  A 600 (-3.0A)
FAD  A 600 (-3.5A)
FAD  A 600 (-2.5A)
FAD  A 600 (-3.9A)
 0.81A 5ergB-1bhyA:
2.9		 5ergB-1bhyA:
20.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1boo PROTEIN (N-4
CYTOSINE-SPECIFIC
METHYLTRANSFERASE
PVU II)

(Proteus
vulgaris) 		PF01555
(N6_N4_Mtase) 		4 GLY A 275
SER A 276
ASP A  34
ASP A 271
 SAH  A 401 (-3.5A)
SAH  A 401 (-2.7A)
SAH  A 401 (-4.0A)
SAH  A 401 ( 4.8A)
 0.70A 5ergB-1booA:
3.9		 5ergB-1booA:
22.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1boo PROTEIN (N-4
CYTOSINE-SPECIFIC
METHYLTRANSFERASE
PVU II)

(Proteus
vulgaris) 		PF01555
(N6_N4_Mtase) 		4 GLY A 275
SER A 276
GLU A 294
ASP A  34
 SAH  A 401 (-3.5A)
SAH  A 401 (-2.7A)
SAH  A 401 (-2.9A)
SAH  A 401 (-4.0A)
 0.75A 5ergB-1booA:
3.9		 5ergB-1booA:
22.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dl5 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Thermotoga
maritima) 		PF01135
(PCMT) 		4 GLY A  83
GLY A  85
GLU A 107
ASP A 134
 SAH  A 699 (-3.2A)
SAH  A 699 (-3.5A)
SAH  A 699 (-2.9A)
SAH  A 699 (-3.5A)
 0.71A 5ergB-1dl5A:
11.5		 5ergB-1dl5A:
23.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fpq ISOLIQUIRITIGENIN
2'-O-METHYLTRANSFERA
SE

(Medicago sativa) 		PF00891
(Methyltransf_2)
PF08100
(Dimerisation) 		4 GLY A 217
GLY A 219
SER A 220
ASP A 260
 SAM  A1699 (-3.6A)
None
None
SAM  A1699 (-3.8A)
 0.70A 5ergB-1fpqA:
10.2		 5ergB-1fpqA:
22.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1i9g HYPOTHETICAL PROTEIN
RV2118C

(Mycobacterium
tuberculosis) 		PF08704
(GCD14)
PF14801
(GCD14_N) 		6 GLY A 107
GLY A 109
SER A 110
GLU A 131
ASP A 161
ASP A 178
 SAM  A 301 (-2.7A)
SAM  A 301 (-3.4A)
SAM  A 301 (-4.4A)
SAM  A 301 (-2.6A)
SAM  A 301 (-3.4A)
SAM  A 301 (-3.4A)
 0.63A 5ergB-1i9gA:
23.7		 5ergB-1i9gA:
25.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jg3 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Pyrococcus
furiosus) 		PF01135
(PCMT) 		5 GLY A  99
GLY A 101
SER A 102
GLU A 121
ASP A 148
 ADN  A 500 (-3.2A)
ADN  A 500 (-3.4A)
None
ADN  A 500 (-2.9A)
ADN  A 500 (-3.7A)
 0.77A 5ergB-1jg3A:
11.5		 5ergB-1jg3A:
21.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1khh GUANIDINOACETATE
METHYLTRANSFERASE

(Rattus
norvegicus) 		no annotation 4 GLY A  67
GLY A  69
GLU A  89
ASP A 134
 SAH  A 236 (-3.3A)
SAH  A 236 (-3.2A)
SAH  A 236 (-2.8A)
SAH  A 236 (-3.4A)
 0.56A 5ergB-1khhA:
12.7		 5ergB-1khhA:
20.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1l5x SURVIVAL PROTEIN E

(Pyrobaculum
aerophilum) 		PF01975
(SurE) 		4 GLY A  15
GLY A  91
SER A  90
ASP A   9
 None
 0.76A 5ergB-1l5xA:
2.2		 5ergB-1l5xA:
21.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mjf SPERMIDINE SYNTHASE

(Pyrococcus
furiosus) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		4 GLY A  82
GLY A  84
ASP A 141
ASP A 158
 None
 0.82A 5ergB-1mjfA:
10.1		 5ergB-1mjfA:
21.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1n7j PHENYLETHANOLAMINE
N-METHYLTRANSFERASE

(Homo sapiens) 		PF01234
(NNMT_PNMT_TEMT) 		4 GLY A  79
GLY A  81
PHE A 102
ASP A 158
 SAH  A2002 (-4.0A)
SAH  A2002 (-3.0A)
SAH  A2002 (-4.4A)
SAH  A2002 (-3.6A)
 0.54A 5ergB-1n7jA:
10.5		 5ergB-1n7jA:
21.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nt2 FIBRILLARIN-LIKE
PRE-RRNA PROCESSING
PROTEIN

(Archaeoglobus
fulgidus) 		PF01269
(Fibrillarin) 		4 GLY A  65
GLU A  88
ASP A 113
ASP A 133
 SAM  A 301 ( 3.8A)
SAM  A 301 (-2.4A)
SAM  A 301 (-3.6A)
SAM  A 301 (-3.7A)
 0.62A 5ergB-1nt2A:
12.7		 5ergB-1nt2A:
20.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1o54 SAM-DEPENDENT
O-METHYLTRANSFERASE

(Thermotoga
maritima) 		PF08704
(GCD14) 		6 GLY A 108
GLY A 110
SER A 111
GLU A 132
ASP A 160
ASP A 176
 None
None
CL  A 266 ( 4.4A)
None
None
None
 0.70A 5ergB-1o54A:
23.9		 5ergB-1o54A:
26.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1o9g RRNA
METHYLTRANSFERASE

(Streptomyces
viridochromogenes) 		PF11599
(AviRa) 		4 GLY A  61
SER A  62
ASP A 153
ASP A  57
 None
 0.82A 5ergB-1o9gA:
12.2		 5ergB-1o9gA:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1p22 F-BOX/WD-REPEAT
PROTEIN 1A

(Homo sapiens) 		PF00400
(WD40)
PF12937
(F-box-like) 		4 GLY A 446
SER A 445
ASP A 489
ASP A 449
 None
 0.79A 5ergB-1p22A:
undetectable		 5ergB-1p22A:
23.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qyr HIGH LEVEL
KASUGAMYCIN
RESISTANCE PROTEIN

(Escherichia
coli) 		PF00398
(RrnaAD) 		4 GLY A  45
GLY A  47
GLU A  66
ASP A  91
 None
 0.70A 5ergB-1qyrA:
12.2		 5ergB-1qyrA:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rc6 HYPOTHETICAL PROTEIN
YLBA

(Escherichia
coli) 		PF05899
(Cupin_3)
PF07883
(Cupin_2) 		4 GLY A1080
GLY A1114
SER A1115
GLU A1079
 None
 0.66A 5ergB-1rc6A:
undetectable		 5ergB-1rc6A:
22.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vbf 231AA LONG
HYPOTHETICAL
PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF01135
(PCMT) 		4 GLY A  78
GLY A  80
GLU A  99
ASP A 124
 None
 0.70A 5ergB-1vbfA:
10.6		 5ergB-1vbfA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wy7 HYPOTHETICAL PROTEIN
PH1948

(Pyrococcus
horikoshii) 		PF05175
(MTS) 		4 GLY A  57
GLY A  59
GLU A  79
ASP A 105
 SAH  A1001 (-3.4A)
SAH  A1001 (-3.3A)
SAH  A1001 (-2.8A)
SAH  A1001 (-3.2A)
 0.56A 5ergB-1wy7A:
14.5		 5ergB-1wy7A:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xcj GUANIDINOACETATE
N-METHYLTRANSFERASE

(Rattus
norvegicus) 		no annotation 4 GLY A  67
GLY A  69
GLU A  89
ASP A 134
 SAH  A 236 (-3.4A)
SAH  A 236 (-3.3A)
SAH  A 236 (-2.9A)
NMG  A 237 ( 3.0A)
 0.53A 5ergB-1xcjA:
13.0		 5ergB-1xcjA:
20.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xkh FERRIPYOVERDINE
RECEPTOR

(Pseudomonas
aeruginosa) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		4 GLY A 258
GLY A 260
SER A 261
ASP A 553
 None
 0.78A 5ergB-1xkhA:
undetectable		 5ergB-1xkhA:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yb2 HYPOTHETICAL PROTEIN
TA0852

(Thermoplasma
acidophilum) 		PF08704
(GCD14) 		6 GLY A  98
GLY A 100
SER A 101
GLU A 122
ASP A 150
ASP A 166
 None
 0.81A 5ergB-1yb2A:
16.1		 5ergB-1yb2A:
23.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zq9 PROBABLE
DIMETHYLADENOSINE
TRANSFERASE

(Homo sapiens) 		PF00398
(RrnaAD) 		4 GLY A  64
GLY A  66
GLU A  85
ASP A 113
 SAM  A4000 (-3.1A)
SAM  A4000 (-3.2A)
SAM  A4000 (-2.8A)
SAM  A4000 (-3.8A)
 0.57A 5ergB-1zq9A:
13.7		 5ergB-1zq9A:
22.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2a14 INDOLETHYLAMINE
N-METHYLTRANSFERASE

(Homo sapiens) 		PF01234
(NNMT_PNMT_TEMT) 		4 GLY A  63
GLY A  65
PHE A  86
ASP A 142
 SAH  A4001 (-3.9A)
SAH  A4001 (-3.0A)
SAH  A4001 (-4.6A)
SAH  A4001 (-3.7A)
 0.52A 5ergB-2a14A:
11.5		 5ergB-2a14A:
20.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2b25 HYPOTHETICAL PROTEIN

(Homo sapiens) 		PF08704
(GCD14) 		6 GLY A 111
GLY A 113
SER A 114
GLU A 135
ASP A 173
ASP A 192
 SAM  A 601 (-2.9A)
SAM  A 601 (-3.2A)
SAM  A 601 (-4.8A)
SAM  A 601 (-2.9A)
SAM  A 601 (-3.4A)
SAM  A 601 (-3.5A)
 0.76A 5ergB-2b25A:
22.0		 5ergB-2b25A:
25.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2di8 FILAMIN-B

(Homo sapiens) 		PF00630
(Filamin) 		4 GLY A   9
GLY A   7
SER A   6
ASP A  38
 None
 0.68A 5ergB-2di8A:
undetectable		 5ergB-2di8A:
15.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fpo METHYLASE YHHF

(Escherichia
coli) 		PF03602
(Cons_hypoth95) 		4 GLY A  62
SER A  63
GLU A  82
ASP A 127
 None
 0.76A 5ergB-2fpoA:
15.6		 5ergB-2fpoA:
23.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gv8 MONOOXYGENASE

(Schizosaccharomyces
pombe) 		PF00743
(FMO-like)
PF13450
(NAD_binding_8) 		4 GLY A  13
GLY A  15
GLU A  38
ASP A 137
 FAD  A 500 (-3.1A)
FAD  A 500 (-3.4A)
FAD  A 500 (-2.5A)
FAD  A 500 (-4.2A)
 0.65A 5ergB-2gv8A:
3.1		 5ergB-2gv8A:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hjs USG-1 PROTEIN
HOMOLOG

(Pseudomonas
aeruginosa) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		4 GLY A  11
GLY A  14
SER A  15
ASP A  58
 None
DIO  A 407 (-3.5A)
DIO  A 407 ( 3.0A)
None
 0.65A 5ergB-2hjsA:
undetectable		 5ergB-2hjsA:
20.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ipx RRNA
2'-O-METHYLTRANSFERA
SE FIBRILLARIN

(Homo sapiens) 		PF01269
(Fibrillarin) 		4 GLY A 168
GLU A 192
ASP A 217
ASP A 237
 MTA  A4001 (-3.3A)
MTA  A4001 (-2.7A)
MTA  A4001 (-3.4A)
MTA  A4001 (-4.3A)
 0.58A 5ergB-2ipxA:
15.4		 5ergB-2ipxA:
20.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2odl ADHESIN

(Haemophilus
influenzae) 		PF05860
(Haemagg_act) 		4 GLY A 401
GLY A 376
ASP A 434
ASP A 400
 None
 0.80A 5ergB-2odlA:
undetectable		 5ergB-2odlA:
23.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2p8u HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
CYTOPLASMIC

(Homo sapiens) 		PF01154
(HMG_CoA_synt_N)
PF08540
(HMG_CoA_synt_C) 		4 GLY A 172
GLY A 342
SER A 338
PHE A  58
 None
 0.69A 5ergB-2p8uA:
undetectable		 5ergB-2p8uA:
21.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pt6 SPERMIDINE SYNTHASE

(Plasmodium
falciparum) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		4 GLY A 124
GLY A 126
ASP A 178
ASP A 196
 S4M  A 501 (-3.4A)
S4M  A 501 ( 4.4A)
S4M  A 501 (-3.3A)
S4M  A 501 (-2.6A)
 0.79A 5ergB-2pt6A:
9.5		 5ergB-2pt6A:
20.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qy6 UPF0209 PROTEIN YFCK

(Escherichia
coli) 		PF05430
(Methyltransf_30) 		4 GLY A  86
GLY A  88
GLU A 121
ASP A 176
 None
 0.58A 5ergB-2qy6A:
9.4		 5ergB-2qy6A:
20.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qy6 UPF0209 PROTEIN YFCK

(Escherichia
coli) 		PF05430
(Methyltransf_30) 		4 GLY A  86
GLY A  88
GLU A 121
ASP A 198
 None
 0.41A 5ergB-2qy6A:
9.4		 5ergB-2qy6A:
20.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v4n MULTIFUNCTIONAL
PROTEIN SUR E

(Salmonella
enterica) 		PF01975
(SurE) 		4 GLY A  15
GLY A  90
SER A  89
ASP A   9
 None
None
None
MG  A1254 (-2.7A)
 0.76A 5ergB-2v4nA:
2.2		 5ergB-2v4nA:
20.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vwq GLUCOSE
DEHYDROGENASE

(Haloferax
mediterranei) 		PF08240
(ADH_N)
PF16912
(Glu_dehyd_C) 		4 GLY A 180
GLY A 182
SER A 183
ASP A 227
 NAP  A 500 ( 3.9A)
NAP  A 500 (-3.3A)
NAP  A 500 (-3.6A)
None
 0.74A 5ergB-2vwqA:
7.0		 5ergB-2vwqA:
22.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x9a ATTACHMENT PROTEIN
G3P
MEMBRANE SPANNING
PROTEIN, REQUIRED
FOR OUTER MEMBRANE
INTEGRITY

(Escherichia
virus If1;
Escherichia
coli) 		PF05357
(Phage_Coat_A)
PF06519
(TolA) 		4 GLY A  42
GLY A  44
ASP A  14
ASP B 417
 None
 0.79A 5ergB-2x9aA:
undetectable		 5ergB-2x9aA:
9.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yvl HYPOTHETICAL PROTEIN

(Aquifex
aeolicus) 		PF08704
(GCD14) 		6 GLY A  99
GLY A 101
SER A 102
GLU A 120
ASP A 148
ASP A 165
 SAM  A 601 (-3.2A)
SAM  A 601 (-3.5A)
SAM  A 601 (-4.6A)
SAM  A 601 (-2.7A)
SAM  A 601 (-3.1A)
SAM  A 601 (-3.4A)
 0.76A 5ergB-2yvlA:
23.1		 5ergB-2yvlA:
25.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yxe PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Methanocaldococcus
jannaschii) 		PF01135
(PCMT) 		4 GLY A  85
GLY A  87
GLU A 109
ASP A 136
 None
 0.64A 5ergB-2yxeA:
11.9		 5ergB-2yxeA:
21.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zsu SPERMIDINE SYNTHASE

(Pyrococcus
horikoshii) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		4 GLY A  84
GLU A 107
ASP A 144
ASP A 161
 None
None
None
AG3  A1001 (-2.8A)
 0.77A 5ergB-2zsuA:
10.4		 5ergB-2zsuA:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zsu SPERMIDINE SYNTHASE

(Pyrococcus
horikoshii) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		4 GLY A  84
GLY A  86
ASP A 144
ASP A 161
 None
None
None
AG3  A1001 (-2.8A)
 0.67A 5ergB-2zsuA:
10.4		 5ergB-2zsuA:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zwv PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE

(Thermus
thermophilus) 		PF05175
(MTS) 		4 GLY A 241
GLY A 243
GLU A 262
ASP A 288
 SAH  A 376 (-3.1A)
SAH  A 376 (-3.4A)
SAH  A 376 (-2.7A)
SAH  A 376 (-4.1A)
 0.75A 5ergB-2zwvA:
13.9		 5ergB-2zwvA:
22.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bew MAJOR
HISTOCOMPATIBILITY
COMPLEX CLASS I
GLYCOPROTEIN
HAPLOTYPE B21

(Gallus gallus) 		PF00129
(MHC_I)
PF07654
(C1-set) 		4 GLY A 109
GLY A  98
ASP A 124
ASP A 100
 None
 0.82A 5ergB-3bewA:
undetectable		 5ergB-3bewA:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3c85 PUTATIVE
GLUTATHIONE-REGULATE
D POTASSIUM-EFFLUX
SYSTEM PROTEIN KEFB

(Vibrio
parahaemolyticus) 		PF02254
(TrkA_N) 		4 GLY A  42
GLY A  44
GLU A  66
ASP A  86
 None
None
None
SO4  A 201 (-4.4A)
 0.64A 5ergB-3c85A:
7.9		 5ergB-3c85A:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fii BOTULINUM NEUROTOXIN
TYPE F

(Clostridium
botulinum) 		PF01742
(Peptidase_M27) 		4 GLY A 186
GLY A 188
SER A 189
ASP A 185
 None
 0.79A 5ergB-3fiiA:
undetectable		 5ergB-3fiiA:
22.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fut DIMETHYLADENOSINE
TRANSFERASE

(Thermus
thermophilus) 		PF00398
(RrnaAD) 		4 GLY A  54
GLY A  56
GLU A  75
ASP A  99
 None
 0.48A 5ergB-3futA:
12.4		 5ergB-3futA:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gry DIMETHYLADENOSINE
TRANSFERASE

(Methanocaldococcus
jannaschii) 		PF00398
(RrnaAD) 		4 GLY A  38
GLY A  40
GLU A  59
ASP A  84
 SAM  A 300 (-3.3A)
SAM  A 300 (-3.3A)
SAM  A 300 (-2.8A)
SAM  A 300 (-3.7A)
 0.66A 5ergB-3gryA:
14.5		 5ergB-3gryA:
20.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iht S-ADENOSYL-L-METHION
INE METHYL
TRANSFERASE

(Ruegeria
pomeroyi) 		PF12692
(Methyltransf_17) 		4 GLY A  47
GLY A  49
GLU A  70
ASP A  90
 SAM  A 200 (-3.3A)
SAM  A 200 (-3.2A)
SAM  A 200 (-2.7A)
SAM  A 200 (-3.2A)
 0.65A 5ergB-3ihtA:
9.6		 5ergB-3ihtA:
18.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lbf PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Escherichia
coli) 		PF01135
(PCMT) 		5 GLY A  83
GLY A  85
SER A  86
GLU A 104
ASP A 131
 SAH  A 300 (-3.4A)
SAH  A 300 (-3.4A)
SAH  A 300 (-2.5A)
SAH  A 300 (-2.9A)
SAH  A 300 (-3.7A)
 0.72A 5ergB-3lbfA:
12.8		 5ergB-3lbfA:
24.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lga SAM-DEPENDENT
METHYLTRANSFERASE

(Pyrococcus
abyssi) 		PF08704
(GCD14)
PF14801
(GCD14_N) 		6 GLY A 101
GLY A 103
SER A 104
GLU A 125
ASP A 153
ASP A 169
 SAH  A 301 (-3.1A)
SAH  A 301 (-3.5A)
SAH  A 301 (-4.4A)
SAH  A 301 (-2.8A)
SAH  A 301 (-3.1A)
SAH  A 301 (-3.6A)
 0.50A 5ergB-3lgaA:
23.4		 5ergB-3lgaA:
26.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ll1 GRIFFITHSIN

(Griffithsia sp.
Q66D336) 		PF01419
(Jacalin) 		4 GLY A  66
GLY A   8
SER A 113
ASP A  67
 CL  A 121 ( 4.5A)
None
None
None
 0.79A 5ergB-3ll1A:
undetectable		 5ergB-3ll1A:
16.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ll7 PUTATIVE
METHYLTRANSFERASE

(Porphyromonas
gingivalis) 		no annotation 4 GLY A 100
GLU A 119
ASP A 148
ASP A 167
 EDO  A 507 ( 3.8A)
None
None
EDO  A 507 (-4.1A)
 0.65A 5ergB-3ll7A:
11.5		 5ergB-3ll7A:
23.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3orh GUANIDINOACETATE
N-METHYLTRANSFERASE

(Homo sapiens) 		no annotation 4 GLY A  68
GLY A  70
GLU A  90
ASP A 135
 SAH  A4000 (-3.4A)
SAH  A4000 (-3.3A)
SAH  A4000 (-2.7A)
SAH  A4000 (-3.7A)
 0.56A 5ergB-3orhA:
12.6		 5ergB-3orhA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3p9n POSSIBLE
METHYLTRANSFERASE
(METHYLASE)

(Mycobacterium
tuberculosis) 		PF03602
(Cons_hypoth95) 		4 GLY A  53
SER A  54
GLU A  73
ASP A 119
 None
 0.71A 5ergB-3p9nA:
15.0		 5ergB-3p9nA:
21.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pgb PUTATIVE
UNCHARACTERIZED
PROTEIN

(Aspergillus
nidulans) 		PF01179
(Cu_amine_oxid)
PF09248
(DUF1965) 		4 GLY A 429
GLY A 427
SER A 424
ASP A 796
 None
 0.83A 5ergB-3pgbA:
undetectable		 5ergB-3pgbA:
19.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ps9 TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC

(Escherichia
coli) 		PF01266
(DAO)
PF05430
(Methyltransf_30) 		5 GLY A  66
GLY A  68
GLU A 101
ASP A 156
ASP A 178
 SAM  A 670 (-3.5A)
SAM  A 670 (-3.2A)
SAM  A 670 (-2.6A)
SAM  A 670 (-3.5A)
SAM  A 670 (-3.4A)
 0.61A 5ergB-3ps9A:
10.5		 5ergB-3ps9A:
19.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ps9 TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC

(Escherichia
coli) 		PF01266
(DAO)
PF05430
(Methyltransf_30) 		5 GLY A  66
GLY A  68
GLU A 101
PHE A 103
ASP A 178
 SAM  A 670 (-3.5A)
SAM  A 670 (-3.2A)
SAM  A 670 (-2.6A)
SAM  A 670 (-4.8A)
SAM  A 670 (-3.4A)
 1.12A 5ergB-3ps9A:
10.5		 5ergB-3ps9A:
19.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pvc TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC

(Yersinia pestis) 		PF01266
(DAO)
PF05430
(Methyltransf_30) 		4 GLY A  66
GLY A  68
GLU A 101
ASP A 156
 None
 0.72A 5ergB-3pvcA:
3.3		 5ergB-3pvcA:
18.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pvc TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC

(Yersinia pestis) 		PF01266
(DAO)
PF05430
(Methyltransf_30) 		4 GLY A  66
GLY A  68
GLU A 101
ASP A 178
 None
 0.60A 5ergB-3pvcA:
3.3		 5ergB-3pvcA:
18.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rom ADP-RIBOSYL CYCLASE
1

(Homo sapiens) 		PF02267
(Rib_hydrolayse) 		4 GLY A 245
GLY A 210
ASP A 282
ASP A 249
 None
 0.76A 5ergB-3romA:
undetectable		 5ergB-3romA:
21.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rw9 SPERMIDINE SYNTHASE

(Homo sapiens) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		4 GLY A 101
GLY A 103
ASP A 155
ASP A 173
 DSH  A 303 (-3.4A)
DSH  A 303 (-3.5A)
DSH  A 303 (-3.5A)
DSH  A 303 (-3.0A)
 0.68A 5ergB-3rw9A:
8.9		 5ergB-3rw9A:
20.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s1s RESTRICTION
ENDONUCLEASE BPUSI

(Bacillus
pumilus) 		PF02384
(N6_Mtase)
PF15516
(BpuSI_N) 		4 GLY A 331
SER A 332
ASP A 388
ASP A 327
 SAH  A 900 (-3.2A)
SAH  A 900 (-2.6A)
SAH  A 900 (-4.1A)
None
 0.74A 5ergB-3s1sA:
9.6		 5ergB-3s1sA:
19.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ssm METHYLTRANSFERASE

(Micromonospora
griseorubida) 		no annotation 4 GLY A 204
GLY A 206
ASP A 252
ASP A 275
 SAH  A 601 (-3.5A)
SAH  A 601 (-3.2A)
SAH  A 601 (-3.6A)
MG  A 501 ( 2.8A)
 0.64A 5ergB-3ssmA:
10.5		 5ergB-3ssmA:
22.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sz7 HSC70 COCHAPERONE
(SGT)

(Aspergillus
fumigatus) 		PF13181
(TPR_8)
PF13414
(TPR_11) 		4 GLY A 215
GLY A 213
GLU A 212
ASP A 218
 None
 0.70A 5ergB-3sz7A:
undetectable		 5ergB-3sz7A:
16.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3uzu RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE A

(Burkholderia
pseudomallei) 		PF00398
(RrnaAD) 		4 GLY A  46
GLY A  48
GLU A  71
ASP A  94
 None
 0.48A 5ergB-3uzuA:
11.7		 5ergB-3uzuA:
21.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vyw MNMC2

(Aquifex
aeolicus) 		PF05430
(Methyltransf_30) 		4 GLY A 104
GLY A 106
GLU A 133
ASP A 193
 SAM  A 501 (-3.6A)
SAM  A 501 (-3.3A)
SAM  A 501 (-2.3A)
SAM  A 501 (-3.8A)
 0.39A 5ergB-3vywA:
10.7		 5ergB-3vywA:
23.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wiw GLYCOSYL HYDROLASE
FAMILY 88

(Pedobacter
heparinus) 		PF07470
(Glyco_hydro_88) 		4 GLY A  76
GLY A  80
PHE A 119
ASP A 116
 None
None
None
EPE  A 501 (-2.8A)
 0.81A 5ergB-3wiwA:
undetectable		 5ergB-3wiwA:
21.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4df3 FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE

(Aeropyrum
pernix) 		PF01269
(Fibrillarin) 		4 GLY A  85
GLU A 109
ASP A 134
ASP A 154
 SAM  A 301 (-3.4A)
SAM  A 301 (-2.9A)
SAM  A 301 (-3.3A)
SAM  A 301 (-3.6A)
 0.37A 5ergB-4df3A:
12.8		 5ergB-4df3A:
20.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gc5 DIMETHYLADENOSINE
TRANSFERASE 1,
MITOCHONDRIAL

(Mus musculus) 		PF00398
(RrnaAD) 		4 GLY A  63
GLY A  65
GLU A  85
ASP A 111
 ACT  A 402 (-3.4A)
None
ACT  A 402 (-2.9A)
None
 0.48A 5ergB-4gc5A:
11.4		 5ergB-4gc5A:
21.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h18 CMT1

(Corynebacterium
glutamicum) 		PF00756
(Esterase) 		4 GLY A 277
GLY A 274
SER A 273
ASP A 109
 None
 0.77A 5ergB-4h18A:
undetectable		 5ergB-4h18A:
22.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hjh PHOSPHOMANNOMUTASE

(Brucella
melitensis) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		4 GLY A 299
GLU A 322
ASP A 261
ASP A 421
 G6Q  A 544 (-3.4A)
G6Q  A 544 (-2.3A)
None
None
 0.83A 5ergB-4hjhA:
undetectable		 5ergB-4hjhA:
22.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4iwh 3-ISOPROPYLMALATE
DEHYDROGENASE

(Burkholderia
thailandensis) 		PF00180
(Iso_dh) 		4 GLY A  10
GLY A  12
ASP A 284
ASP A   9
 None
 0.76A 5ergB-4iwhA:
undetectable		 5ergB-4iwhA:
21.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j9v POTASSIUM UPTAKE
PROTEIN TRKA

(Vibrio
parahaemolyticus) 		PF02080
(TrkA_C)
PF02254
(TrkA_N) 		4 GLY A 239
GLY A 241
GLU A 261
ASP A 283
 AGS  A 502 (-3.3A)
AGS  A 502 (-3.1A)
AGS  A 502 (-2.4A)
AGS  A 502 (-2.9A)
 0.74A 5ergB-4j9vA:
9.6		 5ergB-4j9vA:
22.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jd0 NUCLEOTIDYL
TRANSFERASE

(Thermotoga
maritima) 		PF00483
(NTP_transferase) 		4 GLY A  12
GLY A  10
SER A   9
ASP A 223
 None
GOL  A 314 (-3.3A)
None
None
 0.82A 5ergB-4jd0A:
2.0		 5ergB-4jd0A:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l7v PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Vibrio cholerae) 		PF01135
(PCMT) 		5 GLY A  83
GLY A  85
SER A  86
GLU A 104
ASP A 131
 SAH  A 301 (-3.3A)
SAH  A 301 (-3.5A)
SAH  A 301 (-2.6A)
SAH  A 301 (-2.7A)
SAH  A 301 (-4.0A)
 0.71A 5ergB-4l7vA:
12.5		 5ergB-4l7vA:
22.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4le5 S-ADENOSYLMETHIONINE
SYNTHETASE

(Campylobacter
jejuni) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		4 GLY A 290
GLY A 286
SER A 285
PHE A 129
 None
 0.70A 5ergB-4le5A:
undetectable		 5ergB-4le5A:
23.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4m38 PROTEIN ARGININE
N-METHYLTRANSFERASE
7

(Trypanosoma
brucei) 		PF06325
(PrmA) 		4 GLY A 103
GLY A 105
SER A 106
GLU A 125
 SAH  A 401 (-3.0A)
SAH  A 401 ( 3.8A)
SAH  A 401 (-3.3A)
SAH  A 401 (-3.1A)
 0.42A 5ergB-4m38A:
11.8		 5ergB-4m38A:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nfu EDS1

(Arabidopsis
thaliana) 		PF01764
(Lipase_3) 		4 GLY A  78
GLU A 449
ASP A 446
ASP A  81
 None
None
BGC  A 701 (-3.6A)
None
 0.83A 5ergB-4nfuA:
undetectable		 5ergB-4nfuA:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o29 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Pyrobaculum
aerophilum) 		PF01135
(PCMT) 		5 GLY A  80
GLY A  82
SER A  83
GLU A 104
ASP A 132
 SAH  A 500 (-3.1A)
SAH  A 500 (-3.3A)
SAH  A 500 (-2.9A)
SAH  A 500 (-2.8A)
SAH  A 500 (-4.0A)
 0.84A 5ergB-4o29A:
12.5		 5ergB-4o29A:
21.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o5p UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		PF09994
(DUF2235) 		5 GLY A 118
SER A 130
GLU A 126
PHE A 121
ASP A 123
 None
 1.48A 5ergB-4o5pA:
undetectable		 5ergB-4o5pA:
17.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ucl RNA-DIRECTED RNA
POLYMERASE L

(Human
metapneumovirus) 		no annotation 4 GLY A1696
GLY A1698
ASP A1755
ASP A1779
 None
 0.62A 5ergB-4uclA:
8.4		 5ergB-4uclA:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uoe SPERMIDINE SYNTHASE

(Plasmodium
falciparum) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		4 GLY A 124
GLY A 126
ASP A 178
ASP A 196
 MTA  A 401 (-3.5A)
MTA  A 401 ( 4.5A)
MTA  A 401 (-3.2A)
4ZY  A 501 ( 3.6A)
 0.77A 5ergB-4uoeA:
9.6		 5ergB-4uoeA:
22.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zcf RESTRICTION
ENDONUCLEASE
ECOP15I,
MODIFICATION SUBUNIT

(Escherichia
coli) 		PF01555
(N6_N4_Mtase) 		4 GLY A 443
SER A 444
ASP A 101
ASP A 439
 None
 0.75A 5ergB-4zcfA:
5.2		 5ergB-4zcfA:
21.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zg5 5'-NUCLEOTIDASE SURE

(Brucella
abortus) 		no annotation 4 GLY D  15
GLY D  90
SER D  89
ASP D   9
 None
None
None
MG  D 301 (-2.6A)
 0.65A 5ergB-4zg5D:
undetectable		 5ergB-4zg5D:
21.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bxy RNA
METHYLTRANSFERASE

(Salinibacter
ruber) 		PF13847
(Methyltransf_31) 		4 GLY A  31
GLY A  33
GLU A  53
ASP A  81
 SAH  A 201 (-3.4A)
SAH  A 201 (-3.4A)
SAH  A 201 (-2.8A)
SAH  A 201 (-3.6A)
 0.68A 5ergB-5bxyA:
14.4		 5ergB-5bxyA:
17.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ccx TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
CATALYTIC SUBUNIT
TRMT61A

(Homo sapiens) 		PF08704
(GCD14) 		6 GLY A 111
GLY A 113
SER A 114
GLU A 135
ASP A 163
ASP A 181
 SAH  A 301 (-3.2A)
SAH  A 301 (-2.9A)
SAH  A 301 (-4.4A)
SAH  A 301 (-2.2A)
SAH  A 301 (-2.7A)
SAH  A 301 (-2.4A)
 0.55A 5ergB-5ccxA:
29.0		 5ergB-5ccxA:
34.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5eku ARGININE
N-METHYLTRANSFERASE,
PUTATIVE

(Trypanosoma
brucei) 		PF06325
(PrmA) 		4 GLY A 103
GLY A 105
SER A 106
GLU A 125
 SAH  A 401 (-3.0A)
SAH  A 401 (-3.6A)
SAH  A 401 (-2.7A)
SAH  A 401 (-2.8A)
 0.52A 5ergB-5ekuA:
10.3		 5ergB-5ekuA:
21.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5erg TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
CATALYTIC SUBUNIT
TRM61

(Saccharomyces
cerevisiae) 		PF08704
(GCD14) 		7 GLY B 118
GLY B 120
SER B 121
GLU B 139
PHE B 140
ASP B 168
ASP B 203
 SAM  B 401 (-3.4A)
SAM  B 401 (-3.3A)
SAM  B 401 (-3.1A)
SAM  B 401 (-2.9A)
SAM  B 401 (-4.8A)
SAM  B 401 (-3.5A)
SAM  B 401 (-3.3A)
 0.00A 5ergB-5ergB:
45.3		 5ergB-5ergB:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5f8e METHYLTRANSFERASE

(Mycobacterium
tuberculosis) 		PF13847
(Methyltransf_31) 		4 GLY A 179
GLY A 181
SER A 182
ASP A 229
 SAH  A 400 (-4.0A)
SAH  A 400 (-3.4A)
SAH  A 400 ( 4.7A)
SAH  A 400 (-4.1A)
 0.46A 5ergB-5f8eA:
11.7		 5ergB-5f8eA:
22.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gin FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE

(Sulfolobus
solfataricus) 		PF01269
(Fibrillarin) 		4 GLU E 108
PHE E 109
ASP E 133
ASP E 153
 SAH  E 301 (-3.0A)
SAH  E 301 (-3.6A)
SAH  E 301 (-3.5A)
SAH  E 301 (-3.7A)
 0.75A 5ergB-5ginE:
13.3		 5ergB-5ginE:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gin FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE

(Sulfolobus
solfataricus) 		PF01269
(Fibrillarin) 		4 GLY E  84
GLU E 108
ASP E 133
ASP E 153
 SAH  E 301 (-3.8A)
SAH  E 301 (-3.0A)
SAH  E 301 (-3.5A)
SAH  E 301 (-3.7A)
 0.60A 5ergB-5ginE:
13.3		 5ergB-5ginE:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kss 5'-NUCLEOTIDASE SURE

(Xylella
fastidiosa) 		PF01975
(SurE) 		4 GLY A  15
GLY A  90
SER A  89
ASP A   9
 None
None
None
MN  A 501 (-3.1A)
 0.73A 5ergB-5kssA:
2.4		 5ergB-5kssA:
19.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wcj METHYLTRANSFERASE-LI
KE PROTEIN 13

(Homo sapiens) 		PF01564
(Spermine_synth) 		5 GLY A 501
GLY A 503
GLU A 524
ASP A 551
ASP A 575
 SAH  A 705 (-3.5A)
SAH  A 705 (-3.6A)
SAH  A 705 (-2.7A)
SAH  A 705 (-3.4A)
SAH  A 705 (-3.6A)
 0.68A 5ergB-5wcjA:
12.4		 5ergB-5wcjA:
21.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xhu FERREDOXIN--NADP
REDUCTASE

(Bacillus
subtilis) 		no annotation 4 GLY A  14
GLY A  16
GLU A  37
PHE A  38
 FAD  A1000 (-3.3A)
FAD  A1000 (-3.4A)
FAD  A1000 (-2.7A)
None
 0.72A 5ergB-5xhuA:
4.0		 5ergB-5xhuA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yf0 -

(-) 		no annotation 4 GLY A 208
GLY A 210
GLU A 229
ASP A 295
 SAM  A 505 (-3.3A)
SAM  A 505 ( 3.9A)
SAM  A 505 (-2.9A)
SAM  A 505 (-3.6A)
 0.71A 5ergB-5yf0A:
11.1		 5ergB-5yf0A:
19.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5zw4 PUTATIVE
O-METHYLTRANSFERASE
YRRM

(Bacillus
subtilis) 		no annotation 4 GLY A  62
GLU A  85
ASP A 113
ASP A 133
 SAM  A 302 (-3.4A)
SAM  A 302 (-2.7A)
SAM  A 302 (-3.3A)
SAM  A 302 (-3.6A)
 0.41A 5ergB-5zw4A:
16.9		 5ergB-5zw4A:
22.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6daw NON-HEME IRON
HYDROXYLASE

(Streptomyces
lusitanus) 		no annotation 4 GLY A 281
GLY A  69
ASP A  74
ASP A 282
 None
 0.81A 5ergB-6dawA:
undetectable		 5ergB-6dawA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6f5z 24-STEROL
C-METHYLTRANSFERASE

(Haloferax
volcanii) 		no annotation 4 GLY A  46
GLY A  48
SER A  49
ASP A  93
 SAH  A 301 (-3.5A)
SAH  A 301 ( 3.7A)
None
SAH  A 301 (-3.8A)
 0.69A 5ergB-6f5zA:
13.1		 5ergB-6f5zA:
undetectable